COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186074
Chemical Name: methyl4-{3-[(1E)-2-cyano-3-(morpholin-4-yl)-3-oxoprop-1-en-1-yl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)C(=O)OC)C)/C(=O)N1CCOCC1

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Molecular Weight: 393.44
Empirical Formula: C22H23N3O4

Physical State: Dry powder
Available Amount: 274 mg

Lipinsky:
logP: 2.605
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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